Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM438434
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM438434 |
| SMILES |
CCC(CC1NC1C)NC
|
| InChIKey |
JGQVECSZBHDJSS-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
0.73
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM184519
Similarity: 0.8603
Similarity to MM184519
| Tanimoto metric | 0.8603 |
|---|---|
| Cosine metric | 0.9275 |
| Dice metric | 0.9249 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM184513
Similarity: 0.7794
Similarity to MM184513
| Tanimoto metric | 0.7794 |
|---|---|
| Cosine metric | 0.8828 |
| Dice metric | 0.876 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.47 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM402365
Similarity: 0.7738
Similarity to MM402365
| Tanimoto metric | 0.7738 |
|---|---|
| Cosine metric | 0.8758 |
| Dice metric | 0.8725 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+259 more
